UCSF

ZINC04087599

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2005 22 Yes

Popular Name: Methoprene Methoprene

Find On: PubMed — Wikipedia — Google

CAS Numbers: 40596-69-8 , [40596-69-8]

Other Names:

(+)-Methoprene; (2E,4E,7S)-1-Methylethyl 11-methoxy-3,7,11-trimethyl-2,4-dodecadienoate; (7S)-Methoprene; 2,4-Dodecadienoic acid, 11-methoxy-3,7,11-trimethyl-, 1-methylethyl ester, (2E,4E,7S)-; EPA Pesticide Chemical Code 105402; Flea Killer Plus; Isoprop

(E,E)-1-Methylethyl 11-methoxy-3,7,11-trimethyl-2,4-dodecadienoate; (E,E)-11-methoxy-3,7,11-trimethyl-2,4-dodecadienoic acid 1-methylethyl ester; (E,E)-isopropyl 11-methoxy-3,7,11-trimethyl-2,4-dodecadienoate; Methoprene; ZR 515; isopropyl (2E,4E)-11-meth

(E,E)-1-Methylethyl 11-methoxy-3,7,11-trimethyl-2,4-dodecadienoate; (E,E)-Isopropyl 11-methoxy-3,7,11-trimethyl-2,4-dodecadienoate; 2,4-Dodecadienoic acid, 11-methoxy-3,7,11-trimethyl-, 1-methylethyl ester, (E,E)-; APEX; Altosid; Altosid IGR; Altosid Liqu

(E,E)-1-Methylethyl 11-methoxy-3,7,11-trimethyl-2,4-dodecadienoate; 40596-69-8; C14308; Methoprene

(R)-methoprene

1-methylethyl 11-methoxy-3,7,11-trimethyl-2,4-dodecadienoate; 11-methoxy-3,7,11-trimethyl-2,4-dodecadienoic acid, 1-methylethyl ester

11-Methoxy-3,7,11-trimethyl-2,4-dodecadienoic acid isopropyl ester; 2,4-Dodecadienoic acid, 11-methoxy-3,7,11-trimethyl-, isopropyl ester; Isopropyl 11-methoxy-3,7,11-trimethyldodeca-2,4-dienoate; Isopropyl-11-methoxy-3,7,11-trimethyldodeca-2,4-dienoate

40596-69-8; D08200; Methoprene (INN); Zodiac [veterinary] (TN)

Isopropyl (2E,4E)-11-methoxy-3,7,11-trimethyl-2,4-dodecadienoate

isopropyl (2E,4E,7R)-11-methoxy-3,7,11-trimethyldodeca-2,4-dienoate

isopropyl 11-methoxy-3,7,11-trimethyldodeca-2,4-dienoate

MFCD00072475

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 5.36 11.4 -5.59 0 3 0 36 310.478 11 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0915656A1; WO1997042815A1 IBM Patent Data
Patent Database Links EP1634584; EP1661886; EP1700845; US2004053786; US2004235959; US2006111403; US2007027154; US2007212383; US2007225336; US2007264299; WO2005118552; WO2006023783; WO2006055922; WO2007109870; WO2008150393; WO2008154528 ChEBI
UniProt Database Links RXR_BIOGL ChEBI

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Analogs ( Draw Identity 99% 90% 80% 70% )